Methyl 4-amino-3-methylbenzoate

Name: Methyl 4-amino-3-methylbenzoate
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CAS No. 18595-14-7
Cat. No. CS-W002375
Purity≥98%
MDL No.MFCD00102230

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
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Methyl 4-amino-3-methylbenzoate|CS-W002375

Structure of 18595-14-7

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General Information

CAS No. 18595-14-7
Cat. No. CS-W002375
Purity ≥98%
MDL No. MFCD00102230
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₁₁NO₂
Molecular Weight 165.19
Synonym(s) None
SMILES CC1=CC(C(OC)=O)=CC=C1N

Description

Methyl 4-amino-3-methylbenzoate features a para-amino group flanked by a methyl substituent and ester functionality, enabling efficient incorporation into pharmaceutical intermediates. The electron-rich aromatic core supports diverse coupling reactions under mild conditions, while the bench-stable nature facilitates handling in synthetic workflows.

Application

Methyl 4-amino-3-methylbenzoate serves as a versatile building block in medicinal chemistry and agrochemical synthesis, enabling efficient access to substituted benzimidazoles, quinoline derivatives, and other heterocyclic scaffolds. The ortho-methyl and para-amino groups provide complementary reactivity for sequential functionalization, while the ester moiety supports reliable hydrolysis or reduction under standard conditions. Bench-stable and readily purified by recrystallization, it functions effectively in multi-step syntheses requiring good functional group tolerance and predictable regiochemistry.

Safety Information

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GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

TPSA 52.32
LogP 1.36382
H_Acceptors 3
H_Donors 1
Rotatable_Bonds 1

Other Classifications

Bioactive Molecules Dye and Bio-assay Reagents

Building Blocks Functional Group Amine

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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Methyl 4-amino-3-methylbenzoate

CAS No. 18595-14-7

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